N-[4-(4-bromanylpyrazol-1-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-(4-bromanylpyrazol-1-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[4-(4-bromopyrazol-1-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[4-(4-bromo-1-pyrazolyl)phenyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[4-(4-bromopyrazol-1-yl)phenyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[4-(4-bromopyrazol-1-yl)phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C17H16BrN3O4S MolecularWeight: 438.29564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3C=C(C=N3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3C=C(C=N3)Br)OC

InChI

InChI=1S/C17H16BrN3O4S/c1-24-16-8-7-15(9-17(16)25-2)26(22,23)20-13-3-5-14(6-4-13)21-11-12(18)10-19-21/h3-11,20H,1-2H3